(E)-but-2-enedioic acid; 1-(phenylmethyl)-N-[(E)-3-phenylprop-2-enyl]piperidin-4-amine

Systemtic Name: (E)-but-2-enedioic acid; 1-(phenylmethyl)-N-[(E)-3-phenylprop-2-enyl]piperidin-4-amine Openeye Name: 1-benzyl-N-[(E)-cinnamyl]piperidin-4-amine; fumaric acid CAS Name: (E)-2-butenedioic acid; 1-(phenylmethyl)-N-[(E)-3-phenylprop-2-enyl]-4-piperidinamine IUPAC Name: 1-benzyl-N-[(E)-3-phenylprop-2-enyl]piperidin-4-amine; (E)-but-2-enedioic acid Traditional Name: (1-benzyl-4-piperidyl)-[(E)-cinnamyl]amine; fumaric acid Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCC=CC2=CC=CC=C2)CC3=CC=CC=C3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CN(CCC1NC/C=C/C2=CC=CC=C2)CC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C21H26N2.C4H4O4/c1-3-8-19(9-4-1)12-7-15-22-21-13-16-23(17-14-21)18-20-10-5-2-6-11-20;5-3(6)1-2-4(7)8/h1-12,21-22H,13-18H2;1-2H,(H,5,6)(H,7,8)/b12-7+;2-1+